NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9148 8.3393 109.7391 45.5450 0.0000 174.3155 0 H 4.1378 8.8985 116.3246 60.2804 27.4458 176.0028 2 T 3.5315 7.4226 111.0578 61.0142 67.5053 172.7043 3 K 4.7167 8.7323 128.2426 55.7806 35.4140 175.9061 4 L 5.4524 8.0189 118.3957 53.1400 45.9580 175.1107 5 A 5.1795 8.8458 121.3660 51.1626 23.5379 175.0061 6 L 5.3469 8.7491 118.1134 53.0076 46.0420 176.0940 7 F 5.2345 9.4588 124.7095 56.7464 42.2685 173.5786 8 V 4.7514 8.8311 127.2516 61.1500 33.8656 174.4593 9 R 5.1009 8.8095 126.9121 54.5384 33.0346 175.1812 10 L 5.0088 8.9886 121.9920 53.0858 45.9192 175.1842 11 E 5.1686 8.7912 122.7872 54.4019 31.6368 175.1945 12 A 4.6739 9.1347 128.1695 51.3937 19.3630 177.4066 13 K 4.1000 9.1341 121.8879 55.7215 33.4961 175.1776 14 P 4.7417 0.0000 0.0000 63.6744 31.6974 176.9087 15 G 4.0374 8.9655 111.6578 45.9350 0.0000 174.6276 16 Q 4.5625 8.1552 118.2557 55.8717 28.9829 177.3916 17 E 3.9979 8.0912 122.4776 59.5323 29.5759 178.8883 18 A 4.0157 8.0156 120.1292 55.0298 18.4386 179.3089 19 A 3.9290 7.9156 118.8241 55.1829 18.4491 179.4825 20 L 3.7536 8.0057 118.6953 58.1178 42.0618 178.7942 21 A 3.7753 7.4394 120.6465 55.4359 18.2017 179.4028 22 D 4.2869 8.4497 117.5846 57.2872 40.6493 178.6735 23 F 4.0421 8.1546 120.3836 61.3188 39.7168 176.8171 24 L 4.2051 8.3310 118.3761 57.9280 41.5847 179.4461 25 A 4.1402 8.3281 121.1101 55.1248 18.1341 179.5582 26 S 4.1787 8.1312 111.0442 60.4589 63.4377 175.7085 27 A 3.9048 7.6769 124.1673 53.0369 18.3065 178.6855 28 L 3.4913 7.6046 119.6445 57.9744 42.2340 177.3622 29 P 4.3121 0.0000 0.0000 65.4646 30.9402 178.6538 30 L 3.8426 7.4833 116.5281 57.5078 41.8243 178.7958 31 A 3.7035 7.2339 120.6908 55.0473 17.9156 179.2079 32 N 4.0898 8.0977 114.0346 56.4799 38.7143 176.8050 33 A 4.4004 7.4540 119.1793 52.3886 19.0931 177.2755 34 E 4.2426 8.0100 118.7557 54.9147 28.8795 177.5639 35 S 4.1508 8.6373 120.2008 60.8291 63.2945 175.7288 36 G 3.7694 8.0501 107.5015 46.4709 0.0000 173.6843 37 T 4.4670 7.5830 117.4243 62.3460 67.7567 174.5351 38 T 4.1590 8.3153 124.4147 65.9588 69.1413 175.1147 39 A 4.6377 7.4981 120.7882 50.1791 23.1318 175.1661 40 W 5.1341 7.8060 129.2397 56.2882 34.0529 173.7160 41 F 4.6661 8.9814 125.8116 55.4669 41.9397 173.7370 42 A 4.4406 8.1150 125.6028 50.6212 20.0268 176.1727 43 L 4.6321 8.9808 122.7529 52.5481 45.2927 175.5318 44 K 4.4668 8.2316 122.8915 54.8611 33.8186 175.6136 45 F 4.4507 8.8908 126.6463 58.4526 39.9902 175.6023 46 G 3.9116 7.2023 107.4012 44.4699 0.0000 171.8848 47 P 4.2367 0.0000 0.0000 65.3576 31.2815 177.6365 48 S 4.9990 8.0119 108.7962 57.9708 65.0887 173.1090 49 T 5.0598 7.6041 118.3627 62.3216 71.0491 173.2904 50 F 5.1241 9.3659 124.9512 56.3559 44.0590 173.2781 51 G 4.2842 8.4674 105.1126 46.6782 0.0000 172.5018 52 V 4.9018 8.2668 118.5902 60.9573 35.3491 173.9530 53 F 5.6276 8.9322 129.6475 56.5063 41.9230 173.6888 54 D 5.0798 8.2815 124.0942 51.6944 43.3611 174.0194 55 A 4.7951 8.0871 120.2350 50.3835 23.0595 175.0744 56 F 5.0867 8.8540 116.8506 56.0358 43.4840 175.9613 57 A 4.0990 8.9652 124.3756 54.9688 18.8454 177.5719 58 D 4.7133 7.6807 113.7868 51.2392 43.5231 175.6788 59 E 3.8460 8.7754 119.0989 59.3724 29.4837 178.2846 60 A 4.0555 8.0520 120.4568 55.1265 18.5525 179.7523 61 G 3.5497 8.3662 104.2163 47.8166 0.0000 175.9673 62 R 2.0000 7.6433 121.1733 58.6603 30.0212 178.7211 63 Q 3.8984 8.2419 117.9721 58.7367 28.4314 178.4621 64 A 3.9870 7.7878 121.1503 55.2278 18.6529 178.9586 65 H 4.2428 8.0340 116.5163 59.5270 29.8376 177.6146 66 L 4.0783 7.7170 119.3213 56.9956 41.3621 178.2573 67 N 4.9504 7.8146 114.3813 53.5879 39.4795 175.5394 68 G 4.0805 7.8305 109.7705 43.5428 0.0000 174.5248 69 Q 4.0607 8.3863 117.6485 58.8426 28.5109 178.9567 70 I 3.6954 7.5913 120.3563 64.2336 37.0675 178.0042 71 A 4.0218 7.9292 119.6511 55.1430 18.3268 179.0391 72 A 4.0774 7.8730 117.8434 55.2935 18.5595 179.3917 73 A 4.2338 8.1053 118.3505 55.0179 18.9394 179.7943 74 L 3.7510 8.4097 118.3554 55.4643 42.2930 178.5590 *76 A 4.2879 8.0303 121.7145 51.1462 20.7301 178.0585 77 N 4.8543 7.7068 110.4601 52.9085 39.6916 176.1881 78 A 3.8240 8.1144 123.6561 55.2875 18.6019 180.4754 79 A 3.9739 7.9085 116.9876 55.5584 18.8002 178.9560 80 T 3.9952 7.9710 111.5414 66.2786 68.8960 175.2550 81 L 4.3850 7.8167 119.8359 54.8194 42.9306 176.3229 82 L 5.1859 7.8422 117.9061 52.9041 43.8061 176.6051 83 S 4.5116 8.7819 116.4358 59.0687 63.7662 173.8943 84 S 4.5834 7.3833 113.7211 56.5182 65.2200 172.4031 85 P 4.3955 0.0000 0.0000 61.7244 31.6544 174.6600 86 P 4.3509 0.0000 0.0000 63.6608 32.1116 175.5314 87 N 4.6995 9.1628 123.1145 52.5665 39.8855 173.4743 88 I 4.7292 8.3075 127.5828 59.6252 39.2760 175.0019 89 E 4.7616 9.1304 127.5744 54.3694 31.7312 175.6692 90 K 4.5324 8.7889 124.6608 56.2723 33.2038 176.6250 91 V 4.5808 8.8822 124.1120 61.1825 34.9130 173.8934 92 E 5.0273 8.8834 125.9831 54.9400 31.5107 175.1602 93 L 4.6072 8.6772 124.1353 53.4619 42.2949 177.0651 94 L 4.1277 8.8289 124.2933 57.3449 42.1688 176.8502 95 A 4.4623 7.5831 116.9959 51.7532 21.6016 175.1507 96 A 4.5686 8.3621 121.4851 50.9080 22.1702 175.8290 97 K 4.5609 8.6411 123.8512 54.5401 33.8011 175.3601 98 L 4.9791 8.1311 124.7193 51.8551 45.5724 174.5253 99 P 4.3286 0.0000 0.0000 62.4198 31.8562 176.5397 100 A 4.0095 8.3509 124.3590 53.0711 18.9873 178.0328 101 G 3.8823 8.9583 109.6772 45.7365 0.0000 173.8987 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -1 G 8.34 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 H 8.90 4.14 0.00 3.35 3.42 0.00 5.73 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 T 7.42 3.53 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 3 K 8.73 4.72 0.00 1.75 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.38 1.56 7.81 4 L 8.02 5.45 0.00 1.75 1.64 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 5 A 8.85 5.18 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.75 5.35 0.00 1.99 1.65 1.09 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 7 F 9.46 5.23 0.00 3.31 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.83 4.75 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.01 0.00 0.00 9 R 8.81 5.10 0.00 1.65 1.70 0.00 2.92 0.00 0.00 2.72 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.24 0.00 10 L 8.99 5.01 0.00 1.69 1.59 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.79 5.17 0.00 1.89 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 12 A 9.13 4.67 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 9.13 4.10 0.00 1.78 1.75 0.00 1.95 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.50 7.81 14 P 0.00 4.74 0.00 2.05 2.02 0.00 3.75 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 15 G 8.97 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 8.16 4.56 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.69 0.00 17 E 8.09 4.00 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 18 A 8.02 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.92 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.01 3.75 0.00 1.55 1.29 0.84 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.44 3.78 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.45 4.29 0.00 2.87 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.15 4.04 0.00 3.08 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.33 4.21 0.00 1.95 1.81 0.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.33 4.14 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.13 4.18 0.00 3.93 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.68 3.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.60 3.49 0.00 1.94 1.69 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.31 0.00 2.09 2.01 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 30 L 7.48 3.84 0.00 1.47 1.53 0.78 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.23 3.70 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.10 4.09 0.00 2.73 2.84 0.00 0.00 7.06 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.45 4.40 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.01 4.24 0.00 2.13 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 35 S 8.64 4.15 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.05 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 7.58 4.47 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 38 T 8.32 4.16 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 39 A 7.50 4.64 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 W 7.81 5.13 0.00 3.05 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.98 4.67 0.00 2.93 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.12 4.44 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.98 4.63 0.00 1.43 0.88 1.01 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.23 4.47 0.00 1.79 1.56 0.00 1.88 0.00 0.00 1.68 0.00 0.00 3.13 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.03 0.66 7.81 45 F 8.89 4.45 0.00 3.02 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.20 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.24 0.00 2.06 2.17 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 48 S 8.01 5.00 0.00 3.94 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.60 5.06 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 50 F 9.37 5.12 0.00 2.93 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.47 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.27 4.90 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.96 0.00 0.00 53 F 8.93 5.63 0.00 3.41 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.28 5.08 0.00 2.52 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.09 4.80 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.85 5.09 0.00 2.95 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.97 4.10 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.68 4.71 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.78 3.85 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 60 A 8.05 4.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.37 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.64 2.00 0.00 1.32 1.89 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.99 0.00 63 Q 8.24 3.90 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 64 A 7.79 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 H 8.03 4.24 0.00 3.53 3.45 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.72 4.08 0.00 1.76 1.71 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 67 N 7.81 4.95 0.00 2.74 2.79 0.00 0.00 6.89 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.83 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.39 4.06 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 70 I 7.59 3.70 1.85 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.51 1.08 0.00 0.00 71 A 7.93 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.87 4.08 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 8.11 4.23 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.41 3.75 0.00 1.98 1.84 0.50 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 *76 A 8.03 4.29 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 7.71 4.85 0.00 2.47 2.61 0.00 0.00 6.74 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.11 3.82 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.91 3.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.97 4.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 81 L 7.82 4.39 0.00 1.56 1.55 0.41 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.84 5.19 0.00 1.64 1.67 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 83 S 8.78 4.51 0.00 3.96 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 S 7.38 4.58 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.40 0.00 2.06 2.03 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 86 P 0.00 4.35 0.00 1.95 2.05 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 87 N 9.16 4.70 0.00 2.75 2.69 0.00 0.00 6.86 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.31 4.73 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.79 0.98 0.00 0.00 89 E 9.13 4.76 0.00 2.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 90 K 8.79 4.53 0.00 1.69 1.79 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.48 7.81 91 V 8.88 4.58 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.16 0.00 0.00 92 E 8.88 5.03 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 93 L 8.68 4.61 0.00 1.63 1.68 1.14 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.83 4.13 0.00 1.65 1.74 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.58 4.46 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.36 4.57 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.64 4.56 0.00 1.72 1.72 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.44 7.81 98 L 8.13 4.98 0.00 1.63 1.54 0.97 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.33 0.00 2.05 2.01 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 100 A 8.35 4.01 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.